SCHEMBL8299293

SCHEMBL8299293

Cc1ccc(C(C)Br)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
LMNA P02545 6/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
HTT P42858 2/20 0.38
ALDH1A1 P00352 7/20 0.38
TRPA1 O75762 1/20 0.38
PTGS1 P23219 1/20 0.38
CACNA1C Q13936 1/20 0.38
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37
OPRL1 P41146 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 2/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ACHE P22303 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3518451 0.82 CES2 (0.41) AKR1C3AKR1C2LMNAKMT2AMEN1
SCHEMBL30846954 0.82 CES2 (0.41) AKR1C3AKR1C2LMNAKMT2AMEN1
SCHEMBL84459 0.82 LMNA (0.58) AKR1C3AKR1C2LMNAKMT2AMEN1
SCHEMBL8256534 0.82 AKR1C3 (0.47) AKR1C3AKR1C2LMNAKMT2AMEN1
SCHEMBL25560975 0.81 AKR1C3 (0.41) AKR1C3AKR1C2LMNAKMT2AMEN1
SCHEMBL24569197 0.80 AKR1C3 (0.46) AKR1C3AKR1C2LMNAKMT2AMEN1
SCHEMBL4076370 0.79 LMNA (0.43) LMNAALDH1A1TRPA1PTGS1CACNA1C
SCHEMBL21831869 0.78 KDM1A (0.36) AKR1C3AKR1C2LMNAKMT2AMEN1
SCHEMBL20488728 0.78 AKR1C3 (0.49) AKR1C3AKR1C2LMNAKMT2AMEN1
SCHEMBL22032268 0.78 AKR1C3 (0.45) AKR1C3AKR1C2LMNAKMT2AMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250011289-A1 1H-BENZO[B]AZEPIN-2(3H)-ONE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER J. MICHAEL BISHOP INSTITUTE OF CANCER RESEARCH (CN) 2025-01-09 US disclosed
CN-118525007-A 1H-benzo [ B ] azepin-2 (3H) -one compounds, compositions and methods for treating cancer 成都安泰康赛生物科技有限公司 2024-08-20 CN disclosed
WO-2023088420-A1 1H-BENZO[B]AZEPIN-2(3H)-ONE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER Chengdu Anticancer Bioscience, Ltd. (CN) 2023-05-25 WO disclosed
WO-2004110997-A1 3- SULFONYLAMINO- PYRROLIDINE- 2- ONE DERIVATIVES AS INHIBITORS OF FACTOR XA GLAXO GROUP LIMITED (GB) 2004-12-23 WO disclosed
US-4633026-A DEHYDROHALOGENATION OF RING-HALOGENATED ALPHA- OR BETA-BROMOETHYL BENZENES WITH STRONG BASE, POLYOXYETHYLENE GLYCOL CATALYST, AMINE POLYMERIZATION INHIBITOR ETHYL CORPORATION (US) 1986-12-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250011289-A1 1H-BENZO[B]AZEPIN-2(3H)-ONE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER BRCA1, TP53, BCCIP AKR1C3 3492/4885AKR1C2 2509/4885LMNA 1937/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.